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Interactive animation in molecular dynamics

✍ Scribed by S Todd; I Haneef

Publisher
Elsevier Science
Year
1983
Tongue
English
Weight
399 KB
Volume
1
Category
Article
ISSN
0263-7855

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πŸ“œ SIMILAR VOLUMES

Polarization interactions in lattice dyn
Polarization interactions in lattice dynamics of molecular crystals
✍ Roberto Giua; Vincenzo Schettino πŸ“‚ Article πŸ“… 1984 πŸ› Elsevier Science 🌐 English βš– 384 KB

The conlniution to\_btbce dynamics of molecular crystals of polarization interaction due Lo dipoles induced by the molecular multipolar field has been evaluated by calculation of the lattice frequencies of crystalline ammonia\_ It has been found that this contribution is small but not negligible.

Molecular dynamics of interacting kinks.
Molecular dynamics of interacting kinks. I
✍ Tatsuzo Nagai; Kyozi Kawasaki πŸ“‚ Article πŸ“… 1983 πŸ› Elsevier Science 🌐 English βš– 476 KB

A system consisting of a large number (up to 40 000) of kinks and antikinks moving under attractive interactions, which are annihilated on contacting each other, is studied using the method of molecular dynamics computer simulation. The average distance between neighboring kinks increases logarithmi

Implementation of Ο€-Ο€ interactions in mo
Implementation of Ο€-Ο€ interactions in molecular dynamics simulation
✍ Hitomi Yuki; Yoshikazu Tanaka; Masayuki Hata; Hidenori Ishikawa; Saburo Neya; Ty πŸ“‚ Article πŸ“… 2007 πŸ› John Wiley and Sons 🌐 English βš– 413 KB

## Abstract No explicit π‐π interaction term has been incorporated in the conventional molecular dynamics (MD) simulation programs in spite of its significant role in the folding of biomolecules and the clustering of organic chemicals. In this article, we propose a technique to emphasize the effect